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1-(6'-Methyl-4'-phenyl-1h-pyrazolo[3,4-b]pyridin-3'-yl)-3-phenylthiourea
SpectraBase Compound ID 1cbg4a5t485
InChI InChI=1S/C20H17N5S/c1-13-12-16(14-8-4-2-5-9-14)17-18(21-13)24-25-19(17)23-20(26)22-15-10-6-3-7-11-15/h2-12H,1H3,(H3,21,22,23,24,25,26)
InChIKey RNXYGNLYWLQMSA-UHFFFAOYSA-N
Mol Weight 359.45 g/mol
Molecular Formula C20H17N5S
Exact Mass 359.120467 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1pvOi5NSX6v
Name 1-(6'-Methyl-4'-phenyl-1h-pyrazolo[3,4-b]pyridin-3'-yl)-3-phenylthiourea
Alternate Name(s) 1-(6-methyl-4-phenyl-1H-pyrazolo[3,4-b]pyridin-3-yl)-3-phenylthiourea
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H17N5S
InChI InChI=1S/C20H17N5S/c1-13-12-16(14-8-4-2-5-9-14)17-18(21-13)24-25-19(17)23-20(26)22-15-10-6-3-7-11-15/h2-12H,1H3,(H3,21,22,23,24,25,26)
InChIKey RNXYGNLYWLQMSA-UHFFFAOYSA-N
Molecular Weight 359.451 g/mol
SMILES [nH]1c2c(c(n1)NC(Nc1ccccc1)=S)c(cc(n2)C)-c1ccccc1
SPLASH splash10-0udi-0091000000-349bb883035447c7461e
Source of Spectrum AH-140-578-10
Wiley ID 1696175